methyl 2-(1-methylpyrrol-1-ium-1-yl)ethanoate

Systemtic Name: methyl 2-(1-methylpyrrol-1-ium-1-yl)ethanoate Openeye Name: methyl 2-(1-methylpyrrol-1-ium-1-yl)acetate CAS Name: 2-(1-methyl-1-pyrrol-1-iumyl)acetic acid methyl ester IUPAC Name: methyl 2-(1-methylpyrrol-1-ium-1-yl)acetate Traditional Name: 2-(1-methylpyrrol-1-ium-1-yl)acetic acid methyl ester Formula: C8H12NO2+ MolecularWeight: 154.18638

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C=CC=C1)CC(=O)OC

Isomeric SMILES

C[N+]1(C=CC=C1)CC(=O)OC

InChI

InChI=1S/C8H12NO2/c1-9(5-3-4-6-9)7-8(10)11-2/h3-6H,7H2,1-2H3/q+1